Chem
J-GLOBAL ID:200907033535153510   Nikkaji number:J2.117.465C

[4′′-[5-(Methoxycarbonyl)pentanoylamino]-2′,3′,5′-triphenyl-1,1′:4′,1′′-terbenzene-4-yl]tris(2′,3′,4′,5′-tetraphenyl-4-biphenylyl)methane

[4′′-[5-(メトキシカルボニル)ペンタノイルアミノ]-2′,3′,5′-トリフェニル-1,1′:4′,1′′-テルベンゼン-4-イル]トリス(2′,3′,4′,5′-テトラフェニル-4-ビフェニリル)メタン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C152H111NO3
Molecular formula furigana: C152-H111-N-O3
Molecular weight: 1999.564
InChI: InChI=1S/C152H111NO3/c1-156-139(155)80-48-47-79-138(154)153-129-99-89-124(90-100-129)147-133(108-55-23-5-24-56-108)104-137(146(119-69-37-12-38-70-119)151(147)123-77-45-16-46-78-123)112-87-97-128(98-88-112)152(125-91-81-109(82-92-125)134-101-130(105-49-17-2-18-50-105)140(113-57-25-6-26-58-113)148(120-71-39-13-40-72-120)143(134)116-63-31-9-32-64-116,126-93-83-110(84-94-126)135-102-131(106-51-19-3-20-52-106)141(114-59-27-7-28-60-114)149(121-73-41-14-42-74-121)144(135)117-65-33-10-34-66-117)127-95-85-111(86-96-127)136-103-132(107-53-21-4-22-54-107)142(115-61-29-8-30-62-115)150(122-75-43-15-44-76-122)145(136)118-67-35-11-36-68-118/h2-46,49-78,81-104H,47-48,79-80H2,1H3,(H,153,154)
InChI key: CVYGYLBSEOOPQR-UHFFFAOYSA-N
SMILES: COC(=O)CCCCC(=O)Nc1ccc(cc1)c1c(cc(c2ccc(cc2)C(c2ccc(cc2)c2cc(c3ccccc3)c(c3ccccc3)c(c3ccccc3)c2c2ccccc2)(c2ccc(cc2)c2cc(c3ccccc3)c(c3ccccc3)c(c3ccccc3)c2c2ccccc2)c2ccc(cc2)c2cc(c3ccccc3)c(c3ccccc3)c(c3ccccc3)c2c2ccccc2)c(c2ccccc2)c1c1ccccc1)c1ccccc1
Systematic name  (3):
  • [4′′-[5-(メトキシカルボニル)ペンタノイルアミノ]-2′,3′,5′-トリフェニル-1,1′:4′,1′′-テルベンゼン-4-イル]トリス(2′,3′,4′,5′-テトラフェニル-4-ビフェニリル)メタン
  • メチル 5-{[4-(3,4-ジフェニル-5-{4-[トリス(4-{4,5,6-トリフェニル-[1,1'-ビフェニル]-2-イル}フェニル)メチル]フェニル}-[1,1'-ビフェニル]-2-イル)フェニル]カルバモイル}ペンタノアート
  • methyl 5-{[4-(3,4-diphenyl-5-{4-[tris(4-{4,5,6-triphenyl-[1,1'-biphenyl]-2-yl}phenyl)methyl]phenyl}-[1,1'-biphenyl]-2-yl)phenyl]carbamoyl}pentanoate
Other name (1):
  • [4′′-[5-(Methoxycarbonyl)pentanoylamino]-2′,3′,5′-triphenyl-1,1′:4′,1′′-terbenzene-4-yl]tris(2′,3′,4′,5′-tetraphenyl-4-biphenylyl)methane
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